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CHEBI:223470 - Glysperin C

ChEBI IDCHEBI:223470
ChEBI NameGlysperin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H77N7O19
Net Charge0
Average Mass1008.130
Monoisotopic Mass1007.52742
SMILESC[C@@H](N)C(=O)N[C@@H]1[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](O[C@H]4[C@@H](O)[C@@H](Oc5ccc(C(=O)NCCCNCCCCNCCCCN)cc5)O[C@H]4CO)O[C@H](CO)[C@H]3O)O[C@H]2CO)O[C@H](C)[C@H](N)[C@@H]1O
InChIInChI=1S/C44H77N7O19/c1-21(46)39(61)51-29-31(56)28(47)22(2)63-41(29)68-36-26(19-53)66-42(33(58)32(36)57)70-38-30(55)25(18-52)65-44(35(38)60)69-37-27(20-54)67-43(34(37)59)64-24-10-8-23(9-11-24)40(62)50-17-7-16-49-15-6-5-14-48-13-4-3-12-45/h8-11,21-22,25-38,41-44,48-49,52-60H,3-7,12-20,45-47H2,1-2H3,(H,50,62)(H,51,61)/t21-,22-,25-,26+,27+,28+,29+,30-,31+,32-,33-,34-,35-,36+,37-,38+,41-,42+,43+,44+/m1/s1
InChIKeyRHNHFMNAFLYIKD-QKYJHUFASA-N
Species of MetaboliteComponentSourceComments
Bacillus cereus (ncbitaxon:1396) - PubMed (7275818)
ChEBI Ontology
Outgoing Relation(s)
Glysperin C (CHEBI:223470) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
4-[(2R,3R,4S,5S)-4-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4R,5R,6S)-5-[(2R,3S,4S,5R,6R)-5-amino-3-[[(2R)-2-aminopropanoyl]amino]-4-hydroxy-6-methyloxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-N-[3-[4-(4-aminobutylamino)butylamino]propyl]benzamide
Manual XrefsDatabases
78443097ChemSpider